N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide

C16H27N3O2 — CID 62844299

IUPACN-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide
SMILESCOCCN(C)CCNC(C)c1cccc(NC(C)=O)c1
InChIInChI=1S/C16H27N3O2/c1-13(17-8-9-19(3)10-11-21-4)15-6-5-7-16(12-15)18-14(2)20/h5-7,12-13,17H,8-11H2,1-4H3,(H,18,20)
InChIKeyDTIJCHLYCNADFL-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.87
Rot. Bonds9

About N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide

N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide (PubChem CID 62844299) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide
PubChem CID62844299
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC NameN-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide
SMILESCOCCN(C)CCNC(C)c1cccc(NC(C)=O)c1
InChIInChI=1S/C16H27N3O2/c1-13(17-8-9-19(3)10-11-21-4)15-6-5-7-16(12-15)18-14(2)20/h5-7,12-13,17H,8-11H2,1-4H3,(H,18,20)
InChIKeyDTIJCHLYCNADFL-UHFFFAOYSA-N
XLogP1.87
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 43206933
N-[3-[1-[2-(3-methoxypropoxy)ethylamino]ethyl]phenyl]acetamide
CID 103178645
N'-(2-methoxyethyl)-N-[1-(3-methoxyphenyl)ethyl]-N'-methylethane-1,2-diamine
CID 55126860
methyl 4-[1-(3-acetamidophenyl)ethylamino]butanoate
CID 60782458
N-[3-[1-[2-(2-methylpropoxy)ethylamino]ethyl]phenyl]acetamide
CID 115713617
N-[3-[1-[2-(2-methylprop-2-enoxy)ethylamino]ethyl]phenyl]acetamide
CID 115894064
N-[3-[1-(3-ethoxypropylamino)ethyl]phenyl]acetamide
CID 43201568
N-[3-[1-[[1-(2-methoxyethyl)cyclopropyl]methylamino]ethyl]phenyl]acetamide
CID 103903900
N-[3-[1-[(2-hydroxy-4-methoxy-2-methylbutyl)amino]ethyl]phenyl]acetamide
CID 103784147
N-[3-[1-(3-propoxypropylamino)ethyl]phenyl]acetamide
CID 82940339
4-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenol
CID 55126811
N-[3-[1-(3-methylsulfinylbutylamino)ethyl]phenyl]acetamide
CID 115894505

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide?
The IUPAC name of N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide (CID 62844299) is N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide?
The canonical SMILES for N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide is COCCN(C)CCNC(C)c1cccc(NC(C)=O)c1.
What is the InChIKey of N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide?
The InChIKey is DTIJCHLYCNADFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-13(17-8-9-19(3)10-11-21-4)15-6-5-7-16(12-15)18-14(2)20/h5-7,12-13,17H,8-11H2,1-4H3,(H,18,20).
What are the key properties of N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide?
N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide has a molecular weight of 293.41 g/mol, XLogP of 1.87, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethyl]phenyl]acetamide is sourced from PubChem (CID 62844299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).